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Wax synthase 1 from acinetobacter baylyi (ABWSD1) co-crystallized with myristic acid

Analyse Wax synthase 1 from acinetobacter baylyi (ABWSD1) co-crystallized with myristic… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7NXG
Type
protein
Length
390 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
O-acyltransferase wsd
EC
2.3.1.20, 2.3.1.75
UniProt
Q8GGG1
Ligands
MYR
Pockets
3 · best druggability 0.83

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AO-acyltransferase wsd (EC 2.3.1.20, 2.3.1.75)protein39032% helix, 26% strandQ8GGG1

Ligands and binding sites

  • MYR · Myristic acid · ligand · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

3 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13950.830.9158MYR
2600.420.8215empty
3500.270.7414empty

Compared structures

  • 7NXG · Wax synthase 1 from Acinetobacter baylyi (AbWSD1) co-crystallized with myristic acid · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8GGG1 · AlphaFold monomer V2.0 prediction for O-acyltransferase wsd (Q8GGG1) · a predicted model of the same protein · chain A against A, TM-score 0.91

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